%chk=000195535.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195535

1 1
S -2.651942 0.799944 0.934973
O -1.084605 -0.918944 -0.322753
N 2.493924 -0.429812 -0.191072
C 2.317683 1.042626 0.247653
C 1.861053 -0.652055 -1.546076
C 3.973656 -0.733573 -0.268300
C 1.843182 -1.347702 0.818613
C 0.933973 1.419021 0.239590
C -0.234436 1.728412 0.213716
C -1.616042 2.069892 0.142903
C -2.121191 -0.789571 0.276017
C -3.100092 -1.837846 0.626266
H 2.905485 1.701636 -0.445779
H 2.760537 1.173072 1.270484
H 2.230112 0.067440 -2.296710
H 2.048252 -1.672043 -1.925544
H 0.750666 -0.531990 -1.490792
H 4.478028 -0.578274 0.703845
H 4.160265 -1.785120 -0.561787
H 4.485751 -0.098665 -1.015837
H 2.231836 -1.183401 1.838214
H 0.740853 -1.177894 0.848382
H 1.992950 -2.411903 0.562576
H -1.840039 3.031073 0.678211
H -1.949269 2.228064 -0.913823
H -4.040844 -1.736113 0.049320
H -3.403422 -1.829498 1.689035
H -2.716424 -2.851075 0.409972


%chk=000195535-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000195535

1 1
S -2.774800 0.857084 1.089903
O -1.349157 -0.847801 -0.527918
N 2.552956 -0.434189 -0.193122
C 2.394681 1.052675 0.289258
C 1.859741 -0.626588 -1.544953
C 4.043079 -0.731737 -0.320893
C 1.916799 -1.371623 0.831385
C 1.000730 1.468065 0.326059
C -0.200130 1.743954 0.278866
C -1.619706 2.056273 0.156112
C -2.318212 -0.746947 0.262209
C -3.249391 -1.874432 0.646043
H 2.984100 1.665943 -0.416997
H 2.877599 1.102328 1.282251
H 2.247070 0.121334 -2.253870
H 2.086479 -1.641481 -1.906982
H 0.774198 -0.507798 -1.409871
H 4.538945 -0.534770 0.642338
H 4.176797 -1.788729 -0.595929
H 4.475012 -0.088942 -1.103351
H 2.422952 -1.244329 1.800826
H 0.849889 -1.120731 0.915362
H 2.030939 -2.408078 0.478780
H -1.857508 3.043390 0.587866
H -1.932088 2.043207 -0.901137
H -4.038321 -1.962773 -0.125247
H -3.744700 -1.698708 1.614737
H -2.698056 -2.828896 0.669574


